N~2~-(2-Aminoethyl)-N~2~-[(6-Amino-9H-Purin-9-Yl)Acetyl]-D-Lysine

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Properties Simple | Detailed

Formula C15H24N8O3
IUPAC Name (2r)-6-amino-2-[2-aminoethyl-[2-(6-aminopurine-1,3,7-triium-9-yl)acetyl]amino]hexanoic acid
Molecular Mass 364.403 g·mol−1
Heat of Formation -338.0 ± 16.7 kJ·mol−1
Dipole Moment 3.91 ± 1.08 D
Volume 440.35 Å 3
Surface Area 345.41 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-6-amino-2-[2-aminoethyl-[2-(6-amino-9-purinyl)-1-oxoethyl]amino]hexanoic acid
  • (2r)-6-amino-2-[2-aminoethyl-[2-(6-aminopurin-9-yl)ethanoyl]amino]hexanoic acid
  • 2-aminoethyllysine-carbonylmethylene-adenine
InChIKey PQFIWSOJMDUDKF-SNVBAGLBSA-N
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